SCHEMBL13815922

SCHEMBL13815922

CC(C)CCC(=O)[C@@H](N)CCCCN

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.53
GNAI3 P08754 1/20 0.46
GNAO1 P09471 1/20 0.46
GNAI1 P63096 1/20 0.46
DPP7 Q9UHL4 8/20 0.43
DPP8 Q6V1X1 4/20 0.43
DPP9 Q86TI2 4/20 0.43
DPP4 P27487 2/20 0.41
NMT2 O60551 1/20 0.39
NMT1 P30419 1/20 0.39
CA1 P00915 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
RNPEP Q9H4A4 1/20 0.38
LTA4H P09960 1/20 0.38
FAP Q12884 1/20 0.38
THRB P10828 1/20 0.38
PAOX Q6QHF9 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14640487 0.84 GSR (0.61) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL14117682 0.82 GNAI3 (0.56) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL17029472 0.82 GSR (0.59) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL9840679 0.82 GSR (0.59) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL23788329 0.81 GSR (0.46) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL28327774 0.81 GSR (0.55) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL126835 0.81 GSR (0.53) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL14154835 0.81 GNAI3 (0.58) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL19114834 0.81 GNAI3 (0.58) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL22807654 0.78 GSR (0.55) GSRGNAI3GNAO1GNAI1DPP7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163384-A1 Detection apparatus for biological materials and methods of making and using the same LUCENT TECHNOLOGIES, INC. (US) 2009-06-25 US disclosed